File name: Pandora32s1_GreenbeltMD_20241209_L2Fit_fout2c12d20221109p1-8.txt File generation date: 20241210T050859.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Thomas Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 32 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora32_OF_v1d20220415.txt Instrument calibration file used: Pandora32s1_CF_v12d20221109.txt Level 1 file used: Pandora32s1_GreenbeltMD_20241209_L1_smca1c12d20221109p1-8.txt Full location name: Goddard Space Flight Center Short location name: GreenbeltMD Country of location: USA Location latitude [deg]: 38.9926 Location longitude [deg]: -76.8396 Location altitude [m]: 90 Local noon date: 20241209 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: Based on session 11 with new SO2 and HCHO field cal First and last pixel inside fitting window: 259 401 Nominal wavelengths inside fitting window [nm]: 305.0059 305.1469 305.2878 305.4288 305.5697 305.7106 305.8515 305.9924 306.1333 306.2742 306.4150 306.5559 306.6967 306.8375 306.9783 307.1191 307.2599 307.4007 307.5415 307.6822 307.8230 307.9637 308.1044 308.2451 308.3858 308.5265 308.6672 308.8079 308.9485 309.0892 309.2298 309.3704 309.5110 309.6516 309.7922 309.9328 310.0733 310.2139 310.3544 310.4950 310.6355 310.7760 310.9165 311.0570 311.1974 311.3379 311.4784 311.6188 311.7592 311.8996 312.0400 312.1804 312.3208 312.4612 312.6015 312.7419 312.8822 313.0226 313.1629 313.3032 313.4435 313.5837 313.7240 313.8643 314.0045 314.1447 314.2849 314.4252 314.5654 314.7055 314.8457 314.9859 315.1260 315.2662 315.4063 315.5464 315.6865 315.8266 315.9667 316.1068 316.2468 316.3869 316.5269 316.6669 316.8070 316.9470 317.0869 317.2269 317.3669 317.5069 317.6468 317.7867 317.9266 318.0666 318.2065 318.3463 318.4862 318.6261 318.7659 318.9058 319.0456 319.1854 319.3252 319.4650 319.6048 319.7446 319.8843 320.0241 320.1638 320.3035 320.4432 320.5829 320.7226 320.8623 321.0020 321.1416 321.2813 321.4209 321.5605 321.7001 321.8397 321.9793 322.1189 322.2584 322.3980 322.5375 322.6770 322.8165 322.9560 323.0955 323.2350 323.3745 323.5139 323.6534 323.7928 323.9322 324.0716 324.2110 324.3504 324.4898 324.6291 324.7685 324.9078 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20241209T163811.2Z 9109.693185 195 1 35.72 2 62.11 174.31 106.03 76.60 0.00 1 0.00 1 0 17 1.208e-02 5.760e-03 5.053e-03 1.654e-03 2.812755e-01 8.220020e-04 3.382770e-03 -6.000000e+00 6.791587e-03 223.20 -2.00 3.47 -2.00 317.12 0.00e+00 4.643817e-04 1.136884e-04 7.119687e-05 -6.000000e+00 2.990819e-04 278.84 -2.00 20.00 -2.00 316.48 0.00e+00 2.127 0.000 302.00 328.00 3 4.2569e+00 2.1433e-03 2.5228e-02 -6.0000e+00 1.6728e-02 2.1555e-02 2.4124e-03 1.4044e-02 -6.0000e+00 1.8201e-02 1.8197e-03 1.4577e-03 7.0110e-03 -6.0000e+00 1.0859e-02 -4.2037e-03 7.2698e-04 2.0601e-03 -6.0000e+00 4.6691e-03 6.4628e-04 2.9549e-04 4.6629e-05 2.2883e-05 -6.0000e+00 3.2120e-04 -1.7637e-03 3.3414e-05 12 1 1 12 9 1 99.99 20.87 0.29 -0.00176 0.00046 34 11 1 5 0 1020.510 25.79 20.58 20.87 14.53 5.4 949.04 2660 1702 -2170 -1033 -5030 -6380 -352 -450 2853 -1522 -3009 -3848 -785 548 247 640 -1374 636 -659 1616 1124 -179 2494 -110 -347 357 -212 99 -9 249 335 664 2666 -252 -2108 -2218 -1643 -1881 -1140 -379 -1255 -55 -1096 -648 -165 201 -309 -296 -538 -814 320 979 418 1412 810 1096 609 409 444 513 1269 1332 1736 1342 -33 98 -19 27 647 848 -82 158 111 379 -65 -602 -554 -1115 -859 -480 -1160 -742 -1698 -1692 -947 -780 -45 36 189 369 363 862 -253 888 962 436 58 537 568 -368 -352 -1049 -767 101 -531 -1079 -506 -559 -31 268 37 270 267 275 158 262 357 164 -78 80 -503 78 189 158 498 601 -60 794 443 266 152 107 -57 310 -161 -19 -121 -47 8 -182 70 -401 -546 273 199 -276 -127 -584 -694 -37 -52 361 -215 -434 -560 -121 95 49 141 -326 154 -168 417 300 -48 658 -31 -103 111 -67 30 -3 69 96 204 871 -89 -733 -736 -563 -724 -506 -192 -697 -32 -654 -392 -100 121 -186 -175 -315 -475 192 615 277 968 575 790 448 302 325 370 923 1010 1396 1143 -29 83 -15 21 511 726 -76 152 108 363 -60 -522 -445 -857 -665 -399 -1059 -726 -1761 -1817 -1052 -905 -54 44 234 451 426 955 -266 893 989 480 68 675 752 -494 -458 -1299 -903 118 -656 -1398 -672 -765 -43 390 56 417 408 405 222 351 471 222 -110 117 -757 117 277 228 696 815 -79 1031 595 376 223 160 -87 479 -258 -31 -204 -81 15 -312 117 -656 -878 SS 20241209T164255.7Z 9109.696478 198 1 48.92 2 62.03 175.54 105.15 77.36 0.00 1 0.00 1 0 17 2.361e-02 7.533e-03 1.867e-02 4.396e-03 2.836511e-01 2.177713e-03 3.408919e-03 -6.000000e+00 1.327105e-02 223.20 -2.00 3.47 -2.00 317.91 0.00e+00 5.281511e-04 3.679207e-04 7.484368e-05 -6.000000e+00 5.845879e-04 278.84 -2.00 20.00 -2.00 317.25 0.00e+00 2.121 0.000 302.00 328.00 3 5.9094e+00 5.7652e-03 2.5295e-02 -6.0000e+00 3.2687e-02 4.3408e-02 6.5350e-03 1.4255e-02 -6.0000e+00 3.5569e-02 1.5892e-02 4.1535e-03 7.1320e-03 -6.0000e+00 2.1220e-02 -1.3525e-02 2.1361e-03 2.1306e-03 -6.0000e+00 9.1218e-03 1.2205e-04 3.1476e-04 1.2670e-04 2.3290e-05 -6.0000e+00 6.2784e-04 -3.5002e-04 1.9104e-05 11 9 0 11 8 0 99.99 20.87 0.22 -0.00035 0.00202 41 10 1 5 0 1192.970 25.90 19.44 20.87 15.00 5.4 951.27 13683 -3399 -3164 1237 5929 -10483 4218 -196 2547 -209 -4649 -7072 -185 2334 871 2476 -679 -324 566 6002 1433 -1227 2935 -927 466 495 -122 743 1857 220 3208 -4557 9657 -4221 -771 -2050 -3960 -2360 -1892 479 -2307 223 -1715 19 843 261 -286 561 -189 -611 -1090 -920 74 1388 -1144 1727 661 -106 321 -920 1854 696 1904 632 -672 39 -340 1030 152 1714 -644 -289 732 -26 232 -359 -249 -1232 -1288 -512 -2016 281 -1112 -2178 249 -706 948 394 65 820 516 1676 -530 -152 1103 216 343 975 991 -586 -126 -1108 -1115 -750 -1131 -478 -400 -392 -286 310 567 319 986 10 317 -803 -387 47 62 162 -690 182 -110 -528 363 438 262 281 -228 550 -88 -32 -568 703 250 232 -514 -754 572 392 404 -596 -250 896 -294 -286 105 439 -835 300 -16 229 -21 -485 -757 -20 287 125 391 -118 -58 105 1102 283 -248 574 -196 103 116 -29 169 393 46 672 -1115 2264 -1186 -204 -520 -1065 -713 -675 195 -1071 107 -864 10 423 132 -144 276 -92 -298 -554 -500 42 824 -720 1083 427 -69 206 -587 1173 469 1373 493 -543 30 -244 702 108 1328 -559 -262 666 -23 197 -282 -178 -836 -885 -384 -1711 256 -1096 -2254 266 -804 1121 483 81 992 594 1781 -530 -145 1073 229 398 1224 1326 -802 -164 -1360 -1289 -870 -1394 -620 -537 -546 -414 469 901 520 1576 16 455 -1098 -517 64 89 246 -1083 283 -168 -786 518 602 345 366 -310 795 -134 -51 -902 1135 424 410 -935 -1395 1060 718 721 -1039 -424 SS 20241209T190348.0Z 9109.794306 287 1 49.02 2 68.34 210.63 78.41 98.69 0.00 1 0.00 1 0 25 1.311e-01 2.165e-02 8.803e-02 1.162e-02 3.352060e-01 5.793983e-03 4.055245e-03 -6.000000e+00 7.363284e-02 223.20 -2.00 3.47 -2.00 318.78 0.00e+00 8.816437e-04 1.278762e-03 2.086692e-04 -6.000000e+00 3.254783e-03 278.83 -2.00 20.00 -2.00 318.15 0.00e+00 2.685 0.000 302.00 328.00 3 6.7262e+00 1.5751e-02 3.1457e-02 -6.0000e+00 1.8136e-01 6.7092e-02 1.8072e-02 1.7196e-02 -6.0000e+00 1.9750e-01 3.4258e-02 1.2599e-02 8.5511e-03 -6.0000e+00 1.1774e-01 -1.8010e-02 6.6427e-03 2.6524e-03 -6.0000e+00 5.0917e-02 2.8445e-05 -1.0337e-04 3.3872e-04 2.9300e-05 -6.0000e+00 3.5157e-03 1.6810e-03 -8.9175e-05 12 8 8 10 0 0 99.95 21.11 0.18 0.00168 0.00090 14 3 1 5 0 3500.820 26.00 20.17 21.11 17.02 5.4 962.48 900000 -31835 -35716 -16520 57656 -41758 64979 39334 -26488 8308 -27946 4273 -2764 -10706 -15518 -21529 -5263 -4727 1298 27590 -1162 16602 4530 9312 11955 8938 31643 1552 17070 -16271 3417 -11288 50503 -9457 -7437 -7141 -18865 -2670 -2674 6895 -622 4974 15445 -3042 9154 7488 2978 6438 2260 9706 -9503 6577 -713 5410 -1468 -4117 -3538 -3108 4628 -5011 -381 657 -222 1590 -2129 1527 1886 476 -2281 2784 -1476 -2872 -378 120 -2903 -737 -6114 36 -2920 -1040 -4056 1697 424 -3197 1976 65 1830 2125 -404 2202 -1162 7287 -1455 -1596 -882 -1000 347 2344 4280 -283 128 -2375 -3261 -977 -2039 -490 -1183 -390 809 -330 900 34 1631 -407 1542 -1408 -110 57 -1174 -899 -673 -1268 2491 896 379 -1875 506 -1242 570 2390 -83 2235 -1252 1286 -890 105 331 -2775 1247 -490 564 886 -781 900000 -1953 -2404 -920 1530 -2498 1556 1306 -1782 440 -2085 243 -186 -904 -1592 -2642 -601 -564 155 2687 -153 1853 570 1182 1579 1280 3742 234 2112 -2686 496 -2075 5792 -2010 -1507 -1377 -4255 -594 -710 1978 -214 1728 5045 -1205 3255 2717 1126 2326 844 3406 -4181 2695 -334 2536 -766 -2257 -1979 -1736 2372 -2759 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